3-[1-(4-chloro-3-nitrophenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-[1-(4-chloro-3-nitrophenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
3-[1-(4-chloro-3-nitrophenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | C370-3611 |
| Compound Name: | 3-[1-(4-chloro-3-nitrophenyl)-1H-pyrrol-2-yl]-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 414.83 |
| Molecular Formula: | C17 H11 Cl N6 O3 S |
| Smiles: | Cc1nnc(NC(C(=C/c2cccn2c2ccc(c(c2)[N+]([O-])=O)[Cl])\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.54 |
| logD: | 1.68 |
| logSw: | -4.39 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 223.54 |
| InChI Key: | FPXRYBYPVMFNRP-UHFFFAOYSA-N |